2'-(3,5-dimethylpiperidine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Chemical Structure Depiction of
2'-(3,5-dimethylpiperidine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
2'-(3,5-dimethylpiperidine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Compound characteristics
| Compound ID: | E003-0967 |
| Compound Name: | 2'-(3,5-dimethylpiperidine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one |
| Molecular Weight: | 423.55 |
| Molecular Formula: | C26 H33 N O4 |
| Smiles: | CC1CC(C)CN(C1)C(c1c(C)c2c3C(CC4(CCCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6151 |
| logD: | 5.6151 |
| logSw: | -5.7122 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.594 |
| InChI Key: | VJOBSDJYYVQGOO-UHFFFAOYSA-N |